methyl 4-(4-benzoylpiperazin-1-yl)-3-[2-(morpholin-4-yl)-5-nitrobenzamido]benzoate

methyl 4-(4-benzoylpiperazin-1-yl)-3-[2-(morpholin-4-yl)-5-nitrobenzamido]benzoate

Formula: C30H31N5O7

SMILES: COC(=O)C1=CC=C(N2CCN(CC2)C(=O)C2=CC=CC=C2)C(NC(=O)C2=CC(=CC=C2N2CCOCC2)[N+]([O-])=O)=C1

IUPAC: methyl 4-(4-benzoylpiperazin-1-yl)-3-[2-(morpholin-4-yl)-5-nitrobenzamido]benzoate

InChI: InChI=1S/C30H31N5O7/c1-41-30(38)22-7-9-27(32-11-13-34(14-12-32)29(37)21-5-3-2-4-6-21)25(19-22)31-28(36)24-20-23(35(39)40)8-10-26(24)33-15-17-42-18-16-33/h2-10,19-20H,11-18H2,1H3,(H,31,36)

Composition: C (62.82%), H (5.45%), N (12.21%), O (19.52%)

Molar Mass: 573.606

Atom Count: 73

Heavy Atom Count: 42

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	573.222348358
Formal Charge	0
FSP3	0.3
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	8
Hydrogen Bond Donor Count	1
InChIKey	JIIFTSHWBXZBSL-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	158.86
Topological Polar Surface Area	134.56
Polarizability	57.96
Ring Count	5
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C30H31N5O7		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00